2-(2,4-dioxo-1,3-thiazolidin-3-yl)-N-(2-hydroxyethyl)acetamide

C7H10N2O4S — CID 27409955

IUPAC2-(2,4-dioxo-1,3-thiazolidin-3-yl)-N-(2-hydroxyethyl)acetamide
SMILESO=C(CN1C(=O)CSC1=O)NCCO
InChIInChI=1S/C7H10N2O4S/c10-2-1-8-5(11)3-9-6(12)4-14-7(9)13/h10H,1-4H2,(H,8,11)
InChIKeyCQGAHKPXLMODAY-UHFFFAOYSA-N
MW218.23 g/mol
LogP-1.21
Rot. Bonds4

About 2-(2,4-dioxo-1,3-thiazolidin-3-yl)-N-(2-hydroxyethyl)acetamide

2-(2,4-dioxo-1,3-thiazolidin-3-yl)-N-(2-hydroxyethyl)acetamide (PubChem CID 27409955) has the molecular formula C7H10N2O4S and a molecular weight of 218.23 g/mol. Its IUPAC name is 2-(2,4-dioxo-1,3-thiazolidin-3-yl)-N-(2-hydroxyethyl)acetamide.

Molecular Properties

Compound Name2-(2,4-dioxo-1,3-thiazolidin-3-yl)-N-(2-hydroxyethyl)acetamide
PubChem CID27409955
Molecular FormulaC7H10N2O4S
Molecular Weight218.23 g/mol
Exact Mass218.04
IUPAC Name2-(2,4-dioxo-1,3-thiazolidin-3-yl)-N-(2-hydroxyethyl)acetamide
SMILESO=C(CN1C(=O)CSC1=O)NCCO
InChIInChI=1S/C7H10N2O4S/c10-2-1-8-5(11)3-9-6(12)4-14-7(9)13/h10H,1-4H2,(H,8,11)
InChIKeyCQGAHKPXLMODAY-UHFFFAOYSA-N
XLogP-1.21
TPSA86.71 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.23
LogP ≤ 5-1.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'thioester', 'substructure': 'N/A'}

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Related Compounds

N-(2-hydroxyethyl)-2-oxo-1,3-thiazolidine-4-carboxamide
CID 18961062
1-[2-(Hydroxymethyl)-1,3-thiazolidin-3-yl]-2-(methylamino)ethanone
CID 20699051
1-[4-(Hydroxymethyl)-1,3-thiazolidin-3-yl]-2-(methylamino)ethanone
CID 20699062
(4R)-N-(2-Hydroxyethyl)-2-oxothiazolidine-4-carboxamide
CID 53943884
5-Hydroxy-4-methyl-6-methylsulfanylpiperazin-2-one
CID 123965553
2-Amino-1-[2-(hydroxymethyl)-1,3-thiazolidin-3-yl]ethanone
CID 141925605
(4R)-3-(2-hydroxyethyl)-2-oxo-1,3-thiazolidine-4-carboxamide
CID 142625682
3-[2-(2-Hydroxyethylamino)ethyl]-1,3-thiazolidine-2,4-dione
CID 144287153
3-(2-Aminoethyl)-2-hydroxy-1,3-thiazolidin-4-one
CID 167261225
2-[2-(2,4-Dioxo-1,3-thiazolidin-3-yl)acetylamino]acetic acid
CID 16452208
N-[2-(2,4-Dioxo-1,3-thiazolidin-3-YL)ethyl]-2-hydroxyacetamide
CID 16769173
2-(2,4-dioxo-1,3-thiazolidin-3-yl)-N-ethyl-N-(2-hydroxyethyl)acetamide
CID 27409952

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dioxo-1,3-thiazolidin-3-yl)-N-(2-hydroxyethyl)acetamide?
The IUPAC name of 2-(2,4-dioxo-1,3-thiazolidin-3-yl)-N-(2-hydroxyethyl)acetamide (CID 27409955) is 2-(2,4-dioxo-1,3-thiazolidin-3-yl)-N-(2-hydroxyethyl)acetamide.
What is the SMILES notation for 2-(2,4-dioxo-1,3-thiazolidin-3-yl)-N-(2-hydroxyethyl)acetamide?
The canonical SMILES for 2-(2,4-dioxo-1,3-thiazolidin-3-yl)-N-(2-hydroxyethyl)acetamide is O=C(CN1C(=O)CSC1=O)NCCO.
What is the InChIKey of 2-(2,4-dioxo-1,3-thiazolidin-3-yl)-N-(2-hydroxyethyl)acetamide?
The InChIKey is CQGAHKPXLMODAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O4S/c10-2-1-8-5(11)3-9-6(12)4-14-7(9)13/h10H,1-4H2,(H,8,11).
What are the key properties of 2-(2,4-dioxo-1,3-thiazolidin-3-yl)-N-(2-hydroxyethyl)acetamide?
2-(2,4-dioxo-1,3-thiazolidin-3-yl)-N-(2-hydroxyethyl)acetamide has a molecular weight of 218.23 g/mol, XLogP of -1.21, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dioxo-1,3-thiazolidin-3-yl)-N-(2-hydroxyethyl)acetamide is sourced from PubChem (CID 27409955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).